| Year |
Citation |
Score |
| 2023 |
Saboungi ML, Borodin O, Price DL, Farago B, González MA, Kohara S, Mangin-Thro L, Wildes A, Yamamuro O. Nanoscale structure of a hybrid aqueous-nonaqueous electrolyte. The Journal of Chemical Physics. 158: 124502. PMID 37003746 DOI: 10.1063/5.0138382 |
0.326 |
|
| 2022 |
González MA, Akiba H, Borodin O, Cuello GJ, Hennet L, Kohara S, Maginn EJ, Mangin-Thro L, Yamamuro O, Zhang Y, Price DL, Saboungi ML. Structure of water-in-salt and water-in-bisalt electrolytes. Physical Chemistry Chemical Physics : Pccp. PMID 35451439 DOI: 10.1039/d2cp00537a |
0.329 |
|
| 2022 |
Nürnberg P, Atik J, Borodin O, Winter M, Paillard E, Schönhoff M. Superionicity in Ionic-Liquid-Based Electrolytes Induced by Positive Ion-Ion Correlations. Journal of the American Chemical Society. 144: 4657-4666. PMID 35232022 DOI: 10.1021/jacs.2c00818 |
0.31 |
|
| 2019 |
Raberg JH, Vatamanu J, Harris S, van Oversteeg CHM, Ramos A, Borodin O, Cuk T. Probing Electric Double Layer Composition via in-Situ Vibrational Spectroscopy and Molecular Simulations. The Journal of Physical Chemistry Letters. PMID 31141378 DOI: 10.1021/Acs.Jpclett.9B00879 |
0.326 |
|
| 2019 |
Bedrov D, Piquemal JP, Borodin O, MacKerell AD, Roux B, Schröder C. Molecular Dynamics Simulations of Ionic Liquids and Electrolytes Using Polarizable Force Fields. Chemical Reviews. PMID 31141351 DOI: 10.1021/Acs.Chemrev.8B00763 |
0.411 |
|
| 2018 |
Zhang Y, Su M, Yu X, Zhou Y, Wang J, Cao R, Xu W, Wang C, Baer DR, Borodin O, Xu K, Wang Y, Wang XL, Xu Z, Wang F, et al. Investigation of Ion-Solvent Interactions in Non-Aqueous Electrolytes Using in situ Liquid SIMS. Analytical Chemistry. PMID 29405699 DOI: 10.1021/Acs.Analchem.7B04921 |
0.305 |
|
| 2018 |
Vatamanu J, Borodin O, Bedrov D. Application of Screening Functions as Cut-off Based Alternative to Ewald Summation in Molecular Dynamics Simulations Using Polarizable Force Fields. Journal of Chemical Theory and Computation. PMID 29294281 DOI: 10.1021/acs.jctc.7b01043 |
0.318 |
|
| 2017 |
Borodin O, Suo L, Gobet M, Ren X, Wang F, Faraone A, Peng J, Olguin M, Schroeder M, Ding MS, Gobrogge E, von Wald Cresce A, Munoz S, Dura JA, Greenbaum S, et al. Liquid Structure with Nano-Heterogeneity Promotes Cationic Transport in Concentrated Electrolytes. Acs Nano. PMID 29016112 DOI: 10.1021/Acsnano.7B05664 |
0.322 |
|
| 2017 |
Price DL, Borodin O, González MA, Kofu M, Shibata K, Yamada T, Yamamuro O, Saboungi ML. Relaxation in a Prototype Ionic Liquid: Influence of Water on the Dynamics. The Journal of Physical Chemistry Letters. PMID 28103664 DOI: 10.1021/acs.jpclett.6b02871 |
0.316 |
|
| 2016 |
Vatamanu J, Vatamanu M, Borodin O, Bedrov D. A comparative study of room temperature ionic liquids and their organic solvent mixtures near charged electrodes. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 28: 464002. PMID 27623976 DOI: 10.1088/0953-8984/28/46/464002 |
0.344 |
|
| 2015 |
Lesch V, Li Z, Bedrov D, Borodin O, Heuer A. The influence of cations on lithium ion coordination and transport in ionic liquid electrolytes: a MD simulation study. Physical Chemistry Chemical Physics : Pccp. PMID 26617256 DOI: 10.1039/c5cp05111h |
0.421 |
|
| 2015 |
Borodin O, Olguin M, Ganesh P, Kent PR, Allen JL, Henderson WA. Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry. Physical Chemistry Chemical Physics : Pccp. PMID 26601903 DOI: 10.1039/C5Cp05121E |
0.347 |
|
| 2015 |
Li Z, Borodin O, Smith GD, Bedrov D. Effect of organic solvents on Li+ ion solvation and transport in ionic liquid electrolytes: a molecular dynamics simulation study. The Journal of Physical Chemistry. B. 119: 3085-96. PMID 25592777 DOI: 10.1021/jp510644k |
0.686 |
|
| 2014 |
Seo DM, Boyle PD, Sommer RD, Daubert JS, Borodin O, Henderson WA. Solvate structures and spectroscopic characterization of LiTFSI electrolytes. The Journal of Physical Chemistry. B. 118: 13601-8. PMID 25345716 DOI: 10.1021/Jp505006X |
0.3 |
|
| 2014 |
Haskins JB, Bennett WR, Wu JJ, Hernández DM, Borodin O, Monk JD, Bauschlicher CW, Lawson JW. Computational and experimental investigation of Li-doped ionic liquid electrolytes: [pyr14][TFSI], [pyr13][FSI], and [EMIM][BF4]. The Journal of Physical Chemistry. B. 118: 11295-309. PMID 25159701 DOI: 10.1021/jp5061705 |
0.415 |
|
| 2014 |
Lesch V, Jeremias S, Moretti A, Passerini S, Heuer A, Borodin O. A combined theoretical and experimental study of the influence of different anion ratios on lithium ion dynamics in ionic liquids. The Journal of Physical Chemistry. B. 118: 7367-75. PMID 24905999 DOI: 10.1021/Jp501075G |
0.389 |
|
| 2014 |
Geiculescu OE, Hallac BB, Rajagopal RV, Creager SE, DesMarteau DD, Borodin O, Smith GD. The effect of low-molecular-weight poly(ethylene glycol) (PEG) plasticizers on the transport properties of lithium fluorosulfonimide ionic melt electrolytes. The Journal of Physical Chemistry. B. 118: 5135-43. PMID 24773589 DOI: 10.1021/Jp500826C |
0.658 |
|
| 2013 |
Xing L, Vatamanu J, Borodin O, Bedrov D. On the Atomistic Nature of Capacitance Enhancement Generated by Ionic Liquid Electrolyte Confined in Subnanometer Pores. The Journal of Physical Chemistry Letters. 4: 132-40. PMID 26291225 DOI: 10.1021/jz301782f |
0.33 |
|
| 2013 |
Borodin O, Henderson WA, Fox ET, Berman M, Gobet M, Greenbaum S. Influence of solvent on ion aggregation and transport in PY15TFSI ionic liquid-aprotic solvent mixtures. The Journal of Physical Chemistry. B. 117: 10581-8. PMID 23941158 DOI: 10.1021/jp406541e |
0.458 |
|
| 2013 |
Hu Z, Vatamanu J, Borodin O, Bedrov D. A molecular dynamics simulation study of the electric double layer and capacitance of [BMIM][PF6] and [BMIM][BF4] room temperature ionic liquids near charged surfaces. Physical Chemistry Chemical Physics : Pccp. 15: 14234-47. PMID 23873305 DOI: 10.1039/c3cp51218e |
0.303 |
|
| 2012 |
Hooper JB, Starovoytov ON, Borodin O, Bedrov D, Smith GD. Molecular dynamics simulation studies of the influence of imidazolium structure on the properties of imidazolium/azide ionic liquids. The Journal of Chemical Physics. 136: 194506. PMID 22612102 DOI: 10.1063/1.4718800 |
0.76 |
|
| 2011 |
Starovoytov ON, Borodin O, Bedrov D, Smith GD. Development of a Polarizable Force Field for Molecular Dynamics Simulations of Poly (Ethylene Oxide) in Aqueous Solution. Journal of Chemical Theory and Computation. 7: 1902-15. PMID 26596451 DOI: 10.1021/Ct200064U |
0.736 |
|
| 2011 |
Xing L, Borodin O, Smith GD, Li W. Density functional theory study of the role of anions on the oxidative decomposition reaction of propylene carbonate. The Journal of Physical Chemistry. A. 115: 13896-905. PMID 22004044 DOI: 10.1021/jp206153n |
0.569 |
|
| 2011 |
Vatamanu J, Borodin O, Smith GD. Molecular simulations of the electric double layer structure, differential capacitance, and charging kinetics for N-methyl-N-propylpyrrolidinium bis(fluorosulfonyl)imide at graphite electrodes. The Journal of Physical Chemistry. B. 115: 3073-84. PMID 21384838 DOI: 10.1021/jp2001207 |
0.632 |
|
| 2011 |
Bedrov D, Borodin O. Thermodynamic, dynamic, and structural properties of ionic liquids comprised of 1-butyl-3-methylimidazolium cation and nitrate, azide, or dicyanamide anions. The Journal of Physical Chemistry. B. 114: 12802-10. PMID 20849137 DOI: 10.1021/jp1049827 |
0.371 |
|
| 2010 |
Vatamanu J, Borodin O, Smith GD. Molecular insights into the potential and temperature dependences of the differential capacitance of a room-temperature ionic liquid at graphite electrodes. Journal of the American Chemical Society. 132: 14825-33. PMID 20925318 DOI: 10.1021/ja104273r |
0.599 |
|
| 2010 |
Smith GD, Borodin O, Magda JJ, Boyd RH, Wang Y, Bara JE, Miller S, Gin DL, Noble RD. A comparison of fluoroalkyl-derivatized imidazolium:TFSI and alkyl-derivatized imidazolium:TFSI ionic liquids: a molecular dynamics simulation study. Physical Chemistry Chemical Physics : Pccp. 12: 7064-76. PMID 20485804 DOI: 10.1039/C001387K |
0.773 |
|
| 2010 |
Borodin O, Gorecki W, Smith GD, Armand M. Molecular dynamics simulation and pulsed-field gradient NMR studies of bis(fluorosulfonyl)imide (FSI) and bis[(trifluoromethyl)sulfonyl]imide (TFSI)-based ionic liquids. The Journal of Physical Chemistry. B. 114: 6786-98. PMID 20433203 DOI: 10.1021/Jp911950Q |
0.689 |
|
| 2010 |
Hooper JB, Borodin O. Molecular dynamics simulations of N,N,N,N-tetramethylammonium dicyanamide plastic crystal and liquid using a polarizable force field. Physical Chemistry Chemical Physics : Pccp. 12: 4635-43. PMID 20428543 DOI: 10.1039/b925946e |
0.405 |
|
| 2010 |
Bedrov D, Borodin O, Li Z, Smith GD. Influence of polarization on structural, thermodynamic, and dynamic properties of ionic liquids obtained from molecular dynamics simulations. The Journal of Physical Chemistry. B. 114: 4984-97. PMID 20337454 DOI: 10.1021/jp911670f |
0.676 |
|
| 2010 |
Vatamanu J, Borodin O, Smith GD. Molecular dynamics simulations of atomically flat and nanoporous electrodes with a molten salt electrolyte. Physical Chemistry Chemical Physics : Pccp. 12: 170-82. PMID 20024457 DOI: 10.1039/b917592j |
0.653 |
|
| 2009 |
Bedrov D, Borodin O, Smith GD, Sewell TD, Dattelbaum DM, Stevens LL. A molecular dynamics simulation study of crystalline 1,3,5-triamino-2,4,6-trinitrobenzene as a function of pressure and temperature. The Journal of Chemical Physics. 131: 224703. PMID 20001072 DOI: 10.1063/1.3264972 |
0.607 |
|
| 2009 |
Smith GD, Borodin O, Russo SP, Rees RJ, Hollenkamp AF. A molecular dynamics simulation study of LiFePO4/electrolyte interfaces: structure and Li+ transport in carbonate and ionic liquid electrolytes. Physical Chemistry Chemical Physics : Pccp. 11: 9884-97. PMID 19851568 DOI: 10.1039/b912820d |
0.679 |
|
| 2009 |
Borodin O. Relation between heat of vaporization, ion transport, molar volume, and cation-anion binding energy for ionic liquids. The Journal of Physical Chemistry. B. 113: 12353-7. PMID 19689161 DOI: 10.1021/jp9070357 |
0.313 |
|
| 2009 |
Borodin O. Polarizable force field development and molecular dynamics simulations of ionic liquids. The Journal of Physical Chemistry. B. 113: 11463-78. PMID 19637900 DOI: 10.1021/jp905220k |
0.437 |
|
| 2009 |
Hooper JB, Bedrov D, Smith GD, Hanson B, Borodin O, Dattelbaum DM, Kober EM. A molecular dynamics simulation study of the pressure-volume-temperature behavior of polymers under high pressure. The Journal of Chemical Physics. 130: 144904. PMID 19368468 DOI: 10.1063/1.3077868 |
0.602 |
|
| 2009 |
Borodin O, Smith GD, Kim H. Viscosity of a room temperature ionic liquid: predictions from nonequilibrium and equilibrium molecular dynamics simulations. The Journal of Physical Chemistry. B. 113: 4771-4. PMID 19275203 DOI: 10.1021/jp810016e |
0.642 |
|
| 2009 |
Gomez ED, Panday A, Feng EH, Chen V, Stone GM, Minor AM, Kisielowski C, Downing KH, Borodin O, Smith GD, Balsara NP. Effect of ion distribution on conductivity of block copolymer electrolytes. Nano Letters. 9: 1212-6. PMID 19193125 DOI: 10.1021/Nl900091N |
0.636 |
|
| 2009 |
Borodin O, Smith GD. Quantum chemistry and molecular dynamics simulation study of dimethyl carbonate: ethylene carbonate electrolytes doped with LiPF6. The Journal of Physical Chemistry. B. 113: 1763-76. PMID 19146427 DOI: 10.1021/jp809614h |
0.668 |
|
| 2008 |
Smith GD, Borodin O, Li L, Kim H, Liu Q, Bara JE, Gin DL, Nobel R. A comparison of ether- and alkyl-derivatized imidazolium-based room-temperature ionic liquids: a molecular dynamics simulation study. Physical Chemistry Chemical Physics : Pccp. 10: 6301-12. PMID 18936854 DOI: 10.1039/B808303G |
0.67 |
|
| 2008 |
Pierce F, Tsige M, Borodin O, Perahia D, Grest GS. Interfacial properties of semifluorinated alkane diblock copolymers. The Journal of Chemical Physics. 128: 214903. PMID 18537447 DOI: 10.1063/1.2924120 |
0.348 |
|
| 2008 |
Borodin O, Smith GD, Sewell TD, Bedrov D. Polarizable and nonpolarizable force fields for alkyl nitrates. The Journal of Physical Chemistry. B. 112: 734-42. PMID 18085767 DOI: 10.1021/jp076149f |
0.655 |
|
| 2007 |
Bedrov D, Borodin O, Hanson B, Smith GD. Comment on "On the accuracy of force fields for predicting the physical properties of dimethylnitramine". The Journal of Physical Chemistry. B. 111: 1900-2. PMID 17261062 DOI: 10.1021/jp066662d |
0.562 |
|
| 2006 |
Borodin O, Smith GD, Geiculescu O, Creager SE, Hallac B, DesMarteau D. Li+ transport in lithium sulfonylimide-oligo(ethylene oxide) ionic liquids and oligo(ethylene oxide) doped with LiTFSI. The Journal of Physical Chemistry. B. 110: 24266-74. PMID 17125400 DOI: 10.1021/Jp0653104 |
0.332 |
|
| 2006 |
Borodin O, Smith GD, Fan P. Molecular dynamics simulations of lithium alkyl carbonates. The Journal of Physical Chemistry. B. 110: 22773-9. PMID 17092027 DOI: 10.1021/jp0639142 |
0.691 |
|
| 2006 |
Borodin O, Smith GD, Henderson W. Li+ cation environment, transport, and mechanical properties of the LiTFSI doped N-methyl-N-alkylpyrrolidinium+TFSI- ionic liquids. The Journal of Physical Chemistry. B. 110: 16879-86. PMID 16927976 DOI: 10.1021/Jp061930T |
0.688 |
|
| 2006 |
Borodin O, Smith GD. Structure and dynamics of N-methyl-N-propylpyrrolidinium bis(trifluoromethanesulfonyl)imide ionic liquid from molecular dynamics simulations. The Journal of Physical Chemistry. B. 110: 11481-90. PMID 16771423 DOI: 10.1021/jp061593o |
0.688 |
|
| 2006 |
Borodin O, Smith GD. Development of many-body polarizable force fields for Li-battery applications: 2. LiTFSI-doped Oligoether, polyether, and carbonate-based electrolytes. The Journal of Physical Chemistry. B. 110: 6293-9. PMID 16553447 DOI: 10.1021/jp055080d |
0.699 |
|
| 2006 |
Borodin O, Smith GD. Development of many-body polarizable force fields for Li-battery components: 1. Ether, alkane, and carbonate-based solvents. The Journal of Physical Chemistry. B. 110: 6279-92. PMID 16553446 DOI: 10.1021/jp055079e |
0.675 |
|
| 2006 |
Borodin O, Smith GD. LiTFSI structure and transport in ethylene carbonate from molecular dynamics simulations. The Journal of Physical Chemistry. B. 110: 4971-7. PMID 16526738 DOI: 10.1021/jp056249q |
0.676 |
|
| 2003 |
Smith GD, Bedrov D, Borodin O. Structural relaxation and dynamic heterogeneity in a polymer melt at attractive surfaces. Physical Review Letters. 90: 226103. PMID 12857324 DOI: 10.1103/PhysRevLett.90.226103 |
0.594 |
|
| 2002 |
Smith GD, Borodin O, Bedrov D. A revised quantum chemistry-based potential for poly(ethylene oxide) and its oligomers in aqueous solution. Journal of Computational Chemistry. 23: 1480-8. PMID 12370950 DOI: 10.1002/jcc.10166 |
0.64 |
|
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